Home Aminos 1-amino-4-(methylsulfanyl)butan-2-ol

1-amino-4-(methylsulfanyl)butan-2-ol

CAS No.:
1341098-72-3
Catalog Number:
AG01BV9G
Molecular Formula:
C5H13NOS
Molecular Weight:
135.2278
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Product Description
Catalog Number:
AG01BV9G
Chemical Name:
1-amino-4-(methylsulfanyl)butan-2-ol
CAS Number:
1341098-72-3
Molecular Formula:
C5H13NOS
Molecular Weight:
135.2278
MDL Number:
MFCD20423976
IUPAC Name:
1-amino-4-methylsulfanylbutan-2-ol
InChI:
InChI=1S/C5H13NOS/c1-8-3-2-5(7)4-6/h5,7H,2-4,6H2,1H3
InChI Key:
VRKZLONDSNHQRN-UHFFFAOYSA-N
SMILES:
CSCCC(CN)O
Properties
Complexity:
51.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.072g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
135.225g/mol
Monoisotopic Mass:
135.072g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties